3-(4-chloranyl-1,2,3,6-tetrahydropyridin-5-yl)-5-methyl-1,2-oxazole; ethanedioic acid

Systemtic Name: 3-(4-chloranyl-1,2,3,6-tetrahydropyridin-5-yl)-5-methyl-1,2-oxazole; ethanedioic acid Openeye Name: 3-(4-chloro-1,2,3,6-tetrahydropyridin-5-yl)-5-methyl-isoxazole; oxalic acid CAS Name: 3-(4-chloro-1,2,3,6-tetrahydropyridin-5-yl)-5-methylisoxazole; oxalic acid IUPAC Name: 3-(4-chloro-1,2,3,6-tetrahydropyridin-5-yl)-5-methyl-1,2-oxazole; oxalic acid Traditional Name: 3-(4-chloro-1,2,3,6-tetrahydropyridin-5-yl)-5-methyl-isoxazole; oxalic acid Formula: C11H13ClN2O5 MolecularWeight: 288.68432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C2=C(CCNC2)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=NO1)C2=C(CCNC2)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C9H11ClN2O.C2H2O4/c1-6-4-9(12-13-6)7-5-11-3-2-8(7)10;3-1(4)2(5)6/h4,11H,2-3,5H2,1H3;(H,3,4)(H,5,6)